input word = C00028133

Metabolite InformationStructural formula
Name Dechlorobarbamide
Formula C20H24Cl2N2O2S
Mw 426.09355417
CAS RN 327613-98-9
C_ID C00028133 ,
InChIKey AOEGCPSVMLZAOC-TUAJGTOUNA-N
InChICode InChI=1S/C20H24Cl2N2O2S/c1-14(19(21)22)11-16(26-3)13-18(25)24(2)17(20-23-9-10-27-20)12-15-7-5-4-6-8-15/h4-10,13-14,17,19H,11-12H2,1-3H3/b16-13+/t14-,17-/m0/s1
SMILES c1csc(n1)[C@H](Cc1ccccc1)N(C)C(=O)/C=C(/OC)\C[C@@H](C(Cl)Cl)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp L-Phe L-His
Organism
Kingdom Family Species Reference
--Lyngbya majuscula Ref.
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OrganismLyngbya majuscula
ReferenceSitachitta,Tetrahedron,56,(2000),9103